methyl (2S,4R)-4-(2,2-diphenylethanoylamino)-1-[(4-hydroxyphenyl)methyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4R)-4-(2,2-diphenylethanoylamino)-1-[(4-hydroxyphenyl)methyl]pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4R)-4-[(2,2-diphenylacetyl)amino]-1-[(4-hydroxyphenyl)methyl]pyrrolidine-2-carboxylate CAS Name: (2S,4R)-1-[(4-hydroxyphenyl)methyl]-4-[(1-oxo-2,2-diphenylethyl)amino]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-4-[(2,2-diphenylacetyl)amino]-1-[(4-hydroxyphenyl)methyl]pyrrolidine-2-carboxylate Traditional Name: (2S,4R)-4-[(2,2-diphenylacetyl)amino]-1-(4-hydroxybenzyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CN1CC2=CC=C(C=C2)O)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@@H]1C[C@H](CN1CC2=CC=C(C=C2)O)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O4/c1-33-27(32)24-16-22(18-29(24)17-19-12-14-23(30)15-13-19)28-26(31)25(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-15,22,24-25,30H,16-18H2,1H3,(H,28,31)/t22-,24+/m1/s1